#------------------------------------------------------------------------------
#$Date: 2025-08-22 17:55:42 +0300 (Fri, 22 Aug 2025) $
#$Revision: 301864 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/21/86/7218607.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7218607
loop_
_publ_author_name
'Li, Quan-Quan'
'Kang, Yi-Fan'
'Ren, Chun-Yan'
'Yang, Guo-Ping'
'Liu, Qing Liu, Ping'
'Wang, Yao-Yu'
_publ_section_title
;
 Reaction-controlled assemblies and structural diversities of seven
 Co(ii)/Cu(ii) complexes based on a bipyridine-dicarboxylate N-oxide
 ligand
;
_journal_issue                   4
_journal_name_full               CrystEngComm
_journal_page_first              775
_journal_paper_doi               10.1039/C4CE02008A
_journal_volume                  17
_journal_year                    2015
_chemical_formula_sum            'C48 H48 Cu2 N8 O22'
_chemical_formula_weight         1216.02
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                109.362(4)
_cell_angle_beta                 109.077(4)
_cell_angle_gamma                91.212(4)
_cell_formula_units_Z            1
_cell_length_a                   9.213(2)
_cell_length_b                   12.190(3)
_cell_length_c                   12.635(3)
_cell_measurement_reflns_used    3505
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.59
_cell_measurement_theta_min      2.82
_cell_volume                     1251.8(5)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.975
_diffrn_measured_fraction_theta_max 0.975
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0212
_diffrn_reflns_av_sigmaI/netI    0.0439
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -7
_diffrn_reflns_number            6190
_diffrn_reflns_theta_full        25.10
_diffrn_reflns_theta_max         25.10
_diffrn_reflns_theta_min         1.83
_exptl_absorpt_coefficient_mu    0.944
_exptl_absorpt_correction_T_max  0.8637
_exptl_absorpt_correction_T_min  0.7983
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Bruker SADABS'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.613
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             626
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.16
_refine_diff_density_max         0.487
_refine_diff_density_min         -0.520
_refine_diff_density_rms         0.100
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.052
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     361
_refine_ls_number_reflns         4345
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.052
_refine_ls_R_factor_all          0.0538
_refine_ls_R_factor_gt           0.0450
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0950P)²+1.7921P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1330
_refine_ls_wR_factor_ref         0.1567
_reflns_number_gt                3779
_reflns_number_total             4345
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4ce02008a2.cif
_cod_data_source_block           4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2827 2014-09-09 07:05:25Z andrius 

 Adding full bibliography for 7218604--7218608.cif.
;
_cod_original_sg_symbol_H-M      'P-1   '
_cod_database_code               7218607
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
C1 C 0.3937(4) 0.0995(3) 0.0758(3) 0.0257(7) Uani 1 1 d .
C2 C 0.2449(4) 0.0336(3) -0.0238(3) 0.0235(7) Uani 1 1 d .
C3 C 0.1690(4) -0.0670(3) -0.0244(3) 0.0308(8) Uani 1 1 d .
H3 H 0.2129 -0.0986 0.0345 0.037 Uiso 1 1 calc R
C4 C 0.0275(5) -0.1186(3) -0.1139(4) 0.0360(9) Uani 1 1 d .
H4 H -0.0249 -0.1856 -0.1157 0.043 Uiso 1 1 calc R
C5 C -0.0355(4) -0.0717(3) -0.1997(4) 0.0360(9) Uani 1 1 d .
H5 H -0.1317 -0.1067 -0.2588 0.043 Uiso 1 1 calc R
C6 C 0.1794(4) 0.0754(3) -0.1158(3) 0.0230(7) Uani 1 1 d .
C7 C 0.2505(4) 0.1797(3) -0.1259(3) 0.0245(7) Uani 1 1 d .
C8 C 0.2741(5) 0.3886(3) -0.0625(4) 0.0361(9) Uani 1 1 d .
H8 H 0.2473 0.4590 -0.0212 0.043 Uiso 1 1 calc R
C9 C 0.3700(5) 0.3885(3) -0.1257(4) 0.0364(9) Uani 1 1 d .
H9 H 0.4091 0.4593 -0.1261 0.044 Uiso 1 1 calc R
C10 C 0.4091(5) 0.2853(3) -0.1884(4) 0.0337(8) Uani 1 1 d .
H10 H 0.4760 0.2859 -0.2297 0.040 Uiso 1 1 calc R
C11 C 0.3473(4) 0.1796(3) -0.1892(3) 0.0264(7) Uani 1 1 d .
C12 C 0.3901(4) 0.0658(3) -0.2578(3) 0.0311(8) Uani 1 1 d .
C13 C 0.9048(5) 0.2161(4) 0.4997(4) 0.0407(9) Uani 1 1 d .
H13 H 0.9044 0.1353 0.4712 0.049 Uiso 1 1 calc R
C14 C 1.0273(5) 0.2868(4) 0.6041(4) 0.0511(11) Uani 1 1 d .
H14 H 1.1067 0.2528 0.6434 0.061 Uiso 1 1 calc R
C15 C 1.0286(6) 0.4050(4) 0.6467(4) 0.0496(11) Uani 1 1 d .
H15 H 1.1081 0.4522 0.7161 0.059 Uiso 1 1 calc R
C16 C 0.9103(5) 0.4552(4) 0.5861(4) 0.0388(9) Uani 1 1 d .
C17 C 0.9002(6) 0.5802(4) 0.6211(4) 0.0521(12) Uani 1 1 d .
H17 H 0.9782 0.6325 0.6881 0.063 Uiso 1 1 calc R
C18 C 0.7814(7) 0.6219(4) 0.5595(4) 0.0520(12) Uani 1 1 d .
H18 H 0.7791 0.7025 0.5840 0.062 Uiso 1 1 calc R
C19 C 0.6583(6) 0.5448(3) 0.4567(4) 0.0398(10) Uani 1 1 d .
C20 C 0.6636(4) 0.4235(3) 0.4204(3) 0.0291(8) Uani 1 1 d .
C21 C 0.7927(4) 0.3787(3) 0.4844(3) 0.0296(8) Uani 1 1 d .
C22 C 0.5288(6) 0.5815(4) 0.3893(4) 0.0479(11) Uani 1 1 d .
H22 H 0.5198 0.6611 0.4098 0.057 Uiso 1 1 calc R
C23 C 0.4159(6) 0.5009(4) 0.2936(4) 0.0462(11) Uani 1 1 d .
H23 H 0.3305 0.5250 0.2478 0.055 Uiso 1 1 calc R
C24 C 0.4297(5) 0.3808(4) 0.2648(4) 0.0381(9) Uani 1 1 d .
H24 H 0.3516 0.3262 0.2001 0.046 Uiso 1 1 calc R
Cu1 Cu 0.59513(5) 0.17674(3) 0.30437(4) 0.02532(18) Uani 1 1 d .
N1 N 0.0383(3) 0.0245(3) -0.2010(3) 0.0292(7) Uani 1 1 d .
N2 N 0.2178(4) 0.2850(3) -0.0603(3) 0.0294(7) Uani 1 1 d .
N3 N 0.5495(4) 0.3432(3) 0.3263(3) 0.0292(7) Uani 1 1 d .
N4 N 0.7913(4) 0.2611(3) 0.4416(3) 0.0304(7) Uani 1 1 d .
O1 O 0.3973(3) 0.1038(2) 0.1795(2) 0.0318(6) Uani 1 1 d .
O2 O 0.4955(3) 0.1454(2) 0.0558(2) 0.0346(6) Uani 1 1 d .
O3 O -0.0219(3) 0.0685(3) -0.2847(3) 0.0458(7) Uani 1 1 d .
O4 O 0.3209(3) -0.0279(2) -0.2673(2) 0.0305(6) Uani 1 1 d .
O5 O 0.4934(4) 0.0745(3) -0.2998(4) 0.0585(10) Uani 1 1 d .
O6 O 0.1338(4) 0.2854(2) 0.0050(3) 0.0418(7) Uani 1 1 d .
O1W O 0.5007(4) 0.1418(3) 0.4513(3) 0.0552(9) Uani 1 1 d .
O2W O 0.7195(5) 0.3505(3) 0.1307(4) 0.0677(10) Uani 1 1 d .
O3W O 0.7340(4) 0.2025(3) 0.6978(4) 0.0643(10) Uani 1 1 d .
O4W O 0.8446(5) 0.3587(4) 0.9494(4) 0.0819(13) Uani 1 1 d .
O5W O 0.7870(8) 0.9046(6) 0.4997(5) 0.136(2) Uani 1 1 d .
H1A H 0.4847 0.0687 0.4077 0.205 Uiso 1 1 d R
H1B H 0.5672 0.1582 0.5219 0.205 Uiso 1 1 d R
H2A H 0.6543 0.2891 0.1085 0.205 Uiso 1 1 d R
H2B H 0.7572 0.3517 0.0774 0.205 Uiso 1 1 d R
H3A H 0.8092 0.1612 0.7039 0.205 Uiso 1 1 d R
H3B H 0.6593 0.1618 0.6995 0.205 Uiso 1 1 d R
H4A H 0.9348 0.3351 0.9674 0.205 Uiso 1 1 d R
H4B H 0.8137 0.3120 0.8773 0.205 Uiso 1 1 d R
H5A H 0.8458 0.9550 0.5662 0.205 Uiso 1 1 d R
H5B H 0.7055 0.8916 0.5138 0.205 Uiso 1 1 d R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O2 C1 O1 125.6(3) . .
O2 C1 C2 121.1(3) . .
O1 C1 C2 113.3(3) . .
C6 C2 C3 119.1(3) . .
C6 C2 C1 119.2(3) . .
C3 C2 C1 121.6(3) . .
C4 C3 C2 118.7(4) . .
C4 C3 H3 120.6 . .
C2 C3 H3 120.6 . .
C5 C4 C3 120.1(3) . .
C5 C4 H4 119.9 . .
C3 C4 H4 119.9 . .
N1 C5 C4 121.6(3) . .
N1 C5 H5 119.2 . .
C4 C5 H5 119.2 . .
N1 C6 C2 120.7(3) . .
N1 C6 C7 115.2(3) . .
C2 C6 C7 124.0(3) . .
C11 C7 N2 119.6(3) . .
C11 C7 C6 126.3(3) . .
N2 C7 C6 114.1(3) . .
N2 C8 C9 119.9(3) . .
N2 C8 H8 120.1 . .
C9 C8 H8 120.1 . .
C8 C9 C10 120.8(3) . .
C8 C9 H9 119.6 . .
C10 C9 H9 119.6 . .
C9 C10 C11 119.1(4) . .
C9 C10 H10 120.5 . .
C11 C10 H10 120.5 . .
C7 C11 C10 120.0(3) . .
C7 C11 C12 120.6(3) . .
C10 C11 C12 119.3(3) . .
O4 C12 O5 125.7(3) . .
O4 C12 C11 117.9(3) . .
O5 C12 C11 116.4(3) . .
N4 C13 C14 122.0(4) . .
N4 C13 H13 119.0 . .
C14 C13 H13 119.0 . .
C15 C14 C13 119.5(4) . .
C15 C14 H14 120.3 . .
C13 C14 H14 120.3 . .
C14 C15 C16 119.8(4) . .
C14 C15 H15 120.1 . .
C16 C15 H15 120.1 . .
C15 C16 C21 116.9(4) . .
C15 C16 C17 125.1(4) . .
C21 C16 C17 118.0(4) . .
C18 C17 C16 121.7(4) . .
C18 C17 H17 119.2 . .
C16 C17 H17 119.2 . .
C17 C18 C19 121.1(4) . .
C17 C18 H18 119.4 . .
C19 C18 H18 119.4 . .
C22 C19 C20 116.7(4) . .
C22 C19 C18 124.4(4) . .
C20 C19 C18 118.8(4) . .
N3 C20 C19 123.0(4) . .
N3 C20 C21 116.7(3) . .
C19 C20 C21 120.2(4) . .
N4 C21 C16 123.4(4) . .
N4 C21 C20 116.5(3) . .
C16 C21 C20 120.0(3) . .
C23 C22 C19 120.1(4) . .
C23 C22 H22 120.0 . .
C19 C22 H22 120.0 . .
C22 C23 C24 119.3(4) . .
C22 C23 H23 120.3 . .
C24 C23 H23 120.3 . .
N3 C24 C23 122.2(4) . .
N3 C24 H24 118.9 . .
C23 C24 H24 118.9 . .
O1 Cu1 O4 91.21(11) . 2_655
O1 Cu1 N4 175.37(12) . .
O4 Cu1 N4 92.71(12) 2_655 .
O1 Cu1 N3 94.60(12) . .
O4 Cu1 N3 165.02(12) 2_655 .
N4 Cu1 N3 82.20(13) . .
O1 Cu1 O1W 90.19(12) . .
O4 Cu1 O1W 94.16(11) 2_655 .
N4 Cu1 O1W 87.06(13) . .
N3 Cu1 O1W 99.61(12) . .
O3 N1 C5 121.4(3) . .
O3 N1 C6 119.0(3) . .
C5 N1 C6 119.7(3) . .
O6 N2 C8 120.0(3) . .
O6 N2 C7 119.6(3) . .
C8 N2 C7 120.5(3) . .
C24 N3 C20 118.6(3) . .
C24 N3 Cu1 129.8(3) . .
C20 N3 Cu1 111.7(2) . .
C13 N4 C21 118.4(3) . .
C13 N4 Cu1 128.5(3) . .
C21 N4 Cu1 112.7(2) . .
C1 O1 Cu1 112.9(2) . .
C12 O4 Cu1 122.5(2) . 2_655
Cu1 O1W H1A 86.5 . .
Cu1 O1W H1B 116.6 . .
H1A O1W H1B 113.7 . .
H2A O2W H2B 113.4 . .
H3A O3W H3B 105.4 . .
H4A O4W H4B 93.7 . .
H5A O5W H5B 102.9 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O2 1.218(4) .
C1 O1 1.282(5) .
C1 C2 1.505(5) .
C2 C6 1.387(5) .
C2 C3 1.395(5) .
C3 C4 1.381(6) .
C3 H3 0.9300 .
C4 C5 1.361(6) .
C4 H4 0.9300 .
C5 N1 1.350(5) .
C5 H5 0.9300 .
C6 N1 1.357(4) .
C6 C7 1.480(5) .
C7 C11 1.378(5) .
C7 N2 1.378(5) .
C8 N2 1.368(5) .
C8 C9 1.371(6) .
C8 H8 0.9300 .
C9 C10 1.374(6) .
C9 H9 0.9300 .
C10 C11 1.393(5) .
C10 H10 0.9300 .
C11 C12 1.510(5) .
C12 O4 1.246(4) .
C12 O5 1.249(5) .
C13 N4 1.312(5) .
C13 C14 1.410(6) .
C13 H13 0.9300 .
C14 C15 1.359(7) .
C14 H14 0.9300 .
C15 C16 1.394(7) .
C15 H15 0.9300 .
C16 C21 1.396(5) .
C16 C17 1.453(6) .
C17 C18 1.338(8) .
C17 H17 0.9300 .
C18 C19 1.428(7) .
C18 H18 0.9300 .
C19 C22 1.400(7) .
C19 C20 1.402(5) .
C20 N3 1.358(5) .
C20 C21 1.435(5) .
C21 N4 1.352(5) .
C22 C23 1.362(7) .
C22 H22 0.9300 .
C23 C24 1.405(6) .
C23 H23 0.9300 .
C24 N3 1.315(5) .
C24 H24 0.9300 .
Cu1 O1 1.929(3) .
Cu1 O4 1.961(2) 2_655
Cu1 N4 2.005(3) .
Cu1 N3 2.027(3) .
Cu1 O1W 2.439(3) .
N1 O3 1.312(4) .
N2 O6 1.302(4) .
O4 Cu1 1.960(2) 2_655
O1W H1A 0.8576 .
O1W H1B 0.8552 .
O2W H2A 0.8545 .
O2W H2B 0.8570 .
O3W H3A 0.8636 .
O3W H3B 0.8509 .
O4W H4A 0.8691 .
O4W H4B 0.8454 .
O5W H5A 0.8500 .
O5W H5B 0.8500 .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
O2 C1 C2 C6 -37.5(5) . .
O1 C1 C2 C6 140.7(3) . .
O2 C1 C2 C3 144.1(4) . .
O1 C1 C2 C3 -37.7(4) . .
C6 C2 C3 C4 -2.8(5) . .
C1 C2 C3 C4 175.6(3) . .
C2 C3 C4 C5 0.1(6) . .
C3 C4 C5 N1 1.0(6) . .
C3 C2 C6 N1 4.5(5) . .
C1 C2 C6 N1 -173.9(3) . .
C3 C2 C6 C7 -178.8(3) . .
C1 C2 C6 C7 2.8(5) . .
N1 C6 C7 C11 -90.2(4) . .
C2 C6 C7 C11 92.9(4) . .
N1 C6 C7 N2 92.5(4) . .
C2 C6 C7 N2 -84.4(4) . .
N2 C8 C9 C10 0.8(6) . .
C8 C9 C10 C11 1.3(6) . .
N2 C7 C11 C10 -1.2(5) . .
C6 C7 C11 C10 -178.4(3) . .
N2 C7 C11 C12 177.6(3) . .
C6 C7 C11 C12 0.4(5) . .
C9 C10 C11 C7 -1.1(5) . .
C9 C10 C11 C12 -179.9(3) . .
C7 C11 C12 O4 8.5(5) . .
C10 C11 C12 O4 -172.7(3) . .
C7 C11 C12 O5 -171.1(4) . .
C10 C11 C12 O5 7.7(5) . .
N4 C13 C14 C15 0.3(7) . .
C13 C14 C15 C16 -1.0(7) . .
C14 C15 C16 C21 1.6(7) . .
C14 C15 C16 C17 -178.7(5) . .
C15 C16 C17 C18 -178.8(5) . .
C21 C16 C17 C18 0.8(7) . .
C16 C17 C18 C19 0.6(7) . .
C17 C18 C19 C22 178.6(5) . .
C17 C18 C19 C20 -0.3(7) . .
C22 C19 C20 N3 -1.1(6) . .
C18 C19 C20 N3 177.8(4) . .
C22 C19 C20 C21 179.7(4) . .
C18 C19 C20 C21 -1.4(6) . .
C15 C16 C21 N4 -1.8(6) . .
C17 C16 C21 N4 178.5(4) . .
C15 C16 C21 C20 177.2(4) . .
C17 C16 C21 C20 -2.4(6) . .
N3 C20 C21 N4 2.7(5) . .
C19 C20 C21 N4 -178.1(3) . .
N3 C20 C21 C16 -176.5(3) . .
C19 C20 C21 C16 2.8(5) . .
C20 C19 C22 C23 -0.1(6) . .
C18 C19 C22 C23 -178.9(4) . .
C19 C22 C23 C24 1.0(6) . .
C22 C23 C24 N3 -0.9(6) . .
C4 C5 N1 O3 179.1(4) . .
C4 C5 N1 C6 0.7(5) . .
C2 C6 N1 O3 178.1(3) . .
C7 C6 N1 O3 1.1(4) . .
C2 C6 N1 C5 -3.5(5) . .
C7 C6 N1 C5 179.6(3) . .
C9 C8 N2 O6 176.2(4) . .
C9 C8 N2 C7 -3.3(5) . .
C11 C7 N2 O6 -176.0(3) . .
C6 C7 N2 O6 1.5(5) . .
C11 C7 N2 C8 3.4(5) . .
C6 C7 N2 C8 -179.1(3) . .
C23 C24 N3 C20 -0.3(6) . .
C23 C24 N3 Cu1 179.3(3) . .
C19 C20 N3 C24 1.4(5) . .
C21 C20 N3 C24 -179.4(3) . .
C19 C20 N3 Cu1 -178.3(3) . .
C21 C20 N3 Cu1 0.9(4) . .
O1 Cu1 N3 C24 -5.7(3) . .
O4 Cu1 N3 C24 106.8(5) 2_655 .
N4 Cu1 N3 C24 177.7(4) . .
O1W Cu1 N3 C24 -96.7(3) . .
O1 Cu1 N3 C20 173.9(2) . .
O4 Cu1 N3 C20 -73.6(5) 2_655 .
N4 Cu1 N3 C20 -2.7(2) . .
O1W Cu1 N3 C20 83.0(3) . .
C14 C13 N4 C21 -0.4(6) . .
C14 C13 N4 Cu1 -172.2(3) . .
C16 C21 N4 C13 1.2(6) . .
C20 C21 N4 C13 -177.9(3) . .
C16 C21 N4 Cu1 174.2(3) . .
C20 C21 N4 Cu1 -4.9(4) . .
O1 Cu1 N4 C13 129.8(13) . .
O4 Cu1 N4 C13 -17.9(4) 2_655 .
N3 Cu1 N4 C13 176.3(4) . .
O1W Cu1 N4 C13 76.1(4) . .
O1 Cu1 N4 C21 -42.3(15) . .
O4 Cu1 N4 C21 170.0(3) 2_655 .
N3 Cu1 N4 C21 4.1(2) . .
O1W Cu1 N4 C21 -96.0(3) . .
O2 C1 O1 Cu1 -6.9(5) . .
C2 C1 O1 Cu1 175.0(2) . .
O4 Cu1 O1 C1 -84.3(2) 2_655 .
N4 Cu1 O1 C1 128.0(14) . .
N3 Cu1 O1 C1 81.9(2) . .
O1W Cu1 O1 C1 -178.4(2) . .
O5 C12 O4 Cu1 20.3(6) . 2_655
C11 C12 O4 Cu1 -159.3(2) . 2_655
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1 PubChem 139199413
